4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide

C18H22N2O3S — CID 9301395

IUPAC4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
SMILESC[C@@H](CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C18H22N2O3S/c1-14(15-7-5-4-6-8-15)13-19-18(21)16-9-11-17(12-10-16)24(22,23)20(2)3/h4-12,14H,13H2,1-3H3,(H,19,21)/t14-/m0/s1
InChIKeyYBQXQLRSGYHMHQ-AWEZNQCLSA-N
MW346.45 g/mol
LogP2.47
Rot. Bonds6

About 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide

4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide (PubChem CID 9301395) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
PubChem CID9301395
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
SMILESC[C@@H](CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1
InChIInChI=1S/C18H22N2O3S/c1-14(15-7-5-4-6-8-15)13-19-18(21)16-9-11-17(12-10-16)24(22,23)20(2)3/h4-12,14H,13H2,1-3H3,(H,19,21)/t14-/m0/s1
InChIKeyYBQXQLRSGYHMHQ-AWEZNQCLSA-N
XLogP2.47
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dimethylsulfamoyl)-N-(1-phenylethyl)benzamide
CID 2914743
4-(dimethylsulfamoyl)-N-(3-hydroxy-2-methylpropyl)benzamide
CID 65031807
4-(dimethylsulfamoyl)-N-(3-hydroxy-3-phenylpropyl)benzamide
CID 90499587
3-(dimethylsulfamoyl)-N-[2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl]benzamide
CID 8624154
4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
3-[[4-(dimethylsulfamoyl)benzoyl]amino]-2-methyl-3-phenylpropanoic acid
CID 119218999
4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9301798
4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348
N-[(2S)-2-phenylpropyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 9302382
4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
4-(dimethylsulfamoyl)-N-(3-methyl-1-phenylbutyl)benzamide
CID 46568364
4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164346

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide (CID 9301395) is 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide is C[C@@H](CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide?
The InChIKey is YBQXQLRSGYHMHQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-14(15-7-5-4-6-8-15)13-19-18(21)16-9-11-17(12-10-16)24(22,23)20(2)3/h4-12,14H,13H2,1-3H3,(H,19,21)/t14-/m0/s1.
What are the key properties of 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide?
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide has a molecular weight of 346.45 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide is sourced from PubChem (CID 9301395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).